AG0020MG

175204-90-7 | 3-Pyridinecarboxylic acid, 6-(2,2,2-trifluoroethoxy)-

AG0020MG

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CAS Number	175204-90-7
Catalog Number	AG0020MG(AGN-PC-0KL0O7)
Chemical Name	3-Pyridinecarboxylic acid, 6-(2,2,2-trifluoroethoxy)-
IUPAC Name	6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid
InChI	InChI=1S/C8H6F3NO3/c9-8(10,11)4-15-6-2-1-5(3-12-6)7(13)14/h1-3H,4H2,(H,13,14)
InChI Key	GZOOLXWQKURRPU-UHFFFAOYSA-N
MDL Number	MFCD00110708
Molecular Formula	C8H6F3NO3
Molecular Weight	221.1333
SMILES	O=C(O)C1=CN=C(OCC(F)(F)F)C=C1
Synonyms	6-(2,2,2-trifluoroethoxy)nicotinic acid, 175204-90-7, 6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid, 2-(Trifluoroethoxy)pyridine-5-carboxylic acid, 3-Pyridinecarboxylic acid, 6-(2,2,2-trifluoroethoxy)-, 6-(2,2,2-trifluoro-ethoxy)-nicotinic acid, 3-Pyridinecarboxylicacid, 6-(2,2,2-trifluoroethoxy)-, Maybridge3_005082, PubChem17425, AC1MCZ4L, AC1Q73YZ, MLS000850708, SCHEMBL458559, AC1Q73G1, CHEMBL1380017, CTK0H3928, KS-00003QSX, ZINC77963, DTXSID00381725, GZOOLXWQKURRPU-UHFFFAOYSA-N, HMS1445G22, HMS2778O19, ANW-57595, MFCD00110708, SBB052954, AKOS000263336, AB03442, AS06192, CCG-251761, CM13856, CM13857, MCULE-7175784754, NE32344, PS-6514, IDI1_016469, 6-(2,2,2 trifluroethoxy)nicotinic acid, 6-(2,2,2 trifluoroethoxy)nicotinic acid, AJ-10422, SMR000456725, 6-(2,2,2-trifluoroethoxy) nicotinic acid, DB-017555, RT-010487, FT-0620794, ST24045010, ST50949597, V3811, EN300-26606, 5-Carboxy-2-(2,2,2-trifluoroethoxy)pyridine, A811926, J-011081, J-517986, 6-(2,2,2-trifluoroethoxy)-3-pyridinecarboxylic acid, 6-(2,2,2-trifluoroethoxy)nicotinic acid, AldrichCPR, I14-38202, Z228474594, 6-[(2,2,2-Trifluoroethyl)oxy]-3-pyridinecarboxylic acid, 6-[2,2,2-tris(fluoranyl)ethoxy]pyridine-3-carboxylic acid, C8H6F3NO3, CID2781028, 2-chloro-4-(5-fluoro-2-methylbenzamido)benzoic acid, 3-(3-(Trifluoromethylthio)phenyl)-1H-pyrazol-6-amine, 168080-49-7, 2-chloro-4-[(5-fluoro-2-methylbenzoyl)amino]Benzoic acid, Benzoic acid, 2-chloro-4-[(5-fluoro-2-methylbenzoyl)amino]-,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.03g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.135g/mol
Monoisotopic Mass	221.03g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
Signal Words	warning
UN Code

Certificate of Analysis

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